SCHEMBL4908796

SCHEMBL4908796

COCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3CO)cc2n(C)c1=O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 2/20 0.40
TSHR P16473 1/20 0.39
HIF1A Q16665 7/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
RECQL P46063 1/20 0.37
GRIN2B Q13224 2/20 0.36
GRIN1 Q05586 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
EGLN1 Q9GZT9 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16021048 0.92 MEN1 (0.41) MEN1KMT2AKDM4ETSHRHIF1A
SCHEMBL4906293 0.92 KDM4E (0.48) MEN1KMT2AKDM4ETSHRHIF1A
SCHEMBL4907877 0.92 MEN1 (0.39) MEN1KMT2AKDM4ETSHRHIF1A
SCHEMBL16021049 0.92 GRIN2B (0.41) MEN1KMT2AKDM4ETSHRHIF1A
SCHEMBL14067484 0.92 MEN1 (0.43) MEN1KMT2AKDM4ETSHRHIF1A
SCHEMBL4575745 0.90 MEN1 (0.38) MEN1KMT2AKDM4ETSHRHIF1A
SCHEMBL6064605 0.90 MEN1 (0.40) MEN1KMT2AKDM4ETSHRHIF1A
SCHEMBL4905903 0.90 MEN1 (0.37) MEN1KMT2AKDM4ETSHRHIF1A
SCHEMBL4906427 0.90 MEN1 (0.37) MEN1KMT2AKDM4ETSHRHIF1A
SCHEMBL4904382 0.90 MEN1 (0.37) MEN1KMT2AKDM4ETSHRHIF1A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080214527-A1 Hiv Integrase Inhibitors SHIONOGI & CO. LTD (JP) 2008-09-04 US disclosed
WO-2007019098-A2 HIV INTEGRASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2007-02-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080214527-A1 Hiv Integrase Inhibitors API5, ING2, SAMHD1 MEN1 4841/4885KMT2A 682/4885KDM4E 1139/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.